3-methoxypyridin-4-amine

C6H8N2O — CID 3016738

IUPAC3-methoxypyridin-4-amine
SMILESCOc1cnccc1N
InChIInChI=1S/C6H8N2O/c1-9-6-4-8-3-2-5(6)7/h2-4H,1H3,(H2,7,8)
InChIKeyGPMHHELOMRCBRN-UHFFFAOYSA-N
MW124.14 g/mol
LogP0.67
Rot. Bonds1

About 3-methoxypyridin-4-amine

3-methoxypyridin-4-amine (PubChem CID 3016738) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 3-methoxypyridin-4-amine.

Molecular Properties

Compound Name3-methoxypyridin-4-amine
PubChem CID3016738
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name3-methoxypyridin-4-amine
SMILESCOc1cnccc1N
InChIInChI=1S/C6H8N2O/c1-9-6-4-8-3-2-5(6)7/h2-4H,1H3,(H2,7,8)
InChIKeyGPMHHELOMRCBRN-UHFFFAOYSA-N
XLogP0.67
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxypyridin-4-amine?
The IUPAC name of 3-methoxypyridin-4-amine (CID 3016738) is 3-methoxypyridin-4-amine.
What is the SMILES notation for 3-methoxypyridin-4-amine?
The canonical SMILES for 3-methoxypyridin-4-amine is COc1cnccc1N.
What is the InChIKey of 3-methoxypyridin-4-amine?
The InChIKey is GPMHHELOMRCBRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c1-9-6-4-8-3-2-5(6)7/h2-4H,1H3,(H2,7,8).
What are the key properties of 3-methoxypyridin-4-amine?
3-methoxypyridin-4-amine has a molecular weight of 124.14 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxypyridin-4-amine is sourced from PubChem (CID 3016738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).